1D-1-O-BUTYRYL-4 6-O-DIBENZOYL-MYO-INO-
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1D-1-O-BUTYRYL-4 6-O-DIBENZOYL-MYO-INO-
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CAS No:
153265-90-8
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Formula:
C24H26O9
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Chemical Name:
1D-1-O-BUTYRYL-4 6-O-DIBENZOYL-MYO-INO-
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Synonyms:
1D-1-O-Butyryl-4,6-O-dibenzoyl-myo-inositol;DTXSID50451523;ZINC44122529;J-008996;1D-1-O-Butyryl-4,6-O-dibenzoyl-myo-inositol, >=98.0%;(1R,2S,3R,4R,5R,6S)-4-(Butanoyloxy)-2,5,6-trihydroxycyclohexane-1,3-diyl dibenzoate;[(1R,2S,3R,4R,5R,6S)-3-benzoyloxy-4-butanoyloxy-2,5,6-trihydroxycyclohexyl] benzoate
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CAS No:
Computed Properties
Molecular Weight:458.5
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:458.15768240
Monoisotopic Mass:458.15768240
Topological Polar Surface Area:140
Heavy Atom Count:33
Complexity:669
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1D-1-O-BUTYRYL-4 6-O-DIBENZOYL-MYO-INO-
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